(E)-3-(2-methyl-1,3-dithiolan-2-yl)-2-oxidanyl-but-1-ene-1-diazonium

Systemtic Name: (E)-3-(2-methyl-1,3-dithiolan-2-yl)-2-oxidanyl-but-1-ene-1-diazonium Openeye Name: (E)-2-hydroxy-3-(2-methyl-1,3-dithiolan-2-yl)but-1-ene-1-diazonium CAS Name: (E)-2-hydroxy-3-(2-methyl-1,3-dithiolan-2-yl)-1-butene-1-diazonium IUPAC Name: (E)-2-hydroxy-3-(2-methyl-1,3-dithiolan-2-yl)but-1-ene-1-diazonium Traditional Name: (E)-2-hydroxy-3-(2-methyl-1,3-dithiolan-2-yl)but-1-ene-1-diazonium Formula: C8H13N2OS2+ MolecularWeight: 217.33162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=C[N+]#N)O)C1(SCCS1)C

Isomeric SMILES

CC(/C(=C\[N+]#N)/O)C1(SCCS1)C

InChI

InChI=1S/C8H12N2OS2/c1-6(7(11)5-10-9)8(2)12-3-4-13-8/h5-6H,3-4H2,1-2H3/p+1/b7-5+